SCHEMBL20625976

SCHEMBL20625976

CC(C)(C)OC(=O)NC1CC(n2cc(CCO)nn2)C1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KMT2A Q03164 4/20 0.44
▸ L3MBTL1 Q9Y468 1/20 0.44
▸ ALDH1A1 P00352 1/20 0.38
▸ ELANE P08246 2/20 0.38
▸ BTK Q06187 1/20 0.37
▸ CA12 O43570 2/20 0.37
▸ CA1 P00915 2/20 0.37
▸ CA2 P00918 2/20 0.37
▸ CA9 Q16790 2/20 0.37
▸ MEN1 O00255 3/20 0.36
▸ POLB P06746 1/20 0.36
▸ MAPT P10636 1/20 0.36
▸ GLA P06280 1/20 0.36
▸ KDM1A O60341 1/20 0.36
▸ MAOB P27338 1/20 0.36
▸ JAK2 O60674 1/20 0.36
▸ JAK1 P23458 1/20 0.36
▸ TYK2 P29597 1/20 0.36
▸ JAK3 P52333 1/20 0.36
▸ EPHX2 P34913 1/20 0.36

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL17887435 0.91 KMT2A (0.46) KMT2AL3MBTL1ELANEBTKCA12
SCHEMBL17883548 0.91 KMT2A (0.46) KMT2AL3MBTL1ELANEBTKCA12
SCHEMBL25728922 0.84 KMT2A (0.43) KMT2AL3MBTL1ELANEBTKCA12
SCHEMBL17374252 0.83 ELANE (0.44) KMT2AL3MBTL1ELANEBTKKDM1A
SCHEMBL17381917 0.81 KMT2A (0.49) KMT2AL3MBTL1ELANEBTKCA1
SCHEMBL17374331 0.75 KMT2A (0.49) KMT2AL3MBTL1BTKKDM1AMAOB
SCHEMBL17374328 0.75 KMT2A (0.49) KMT2AL3MBTL1BTKKDM1AMAOB
SCHEMBL18617792 0.74 KMT2A (0.44) KMT2AL3MBTL1BTKKDM1AMAOB
SCHEMBL20204365 0.74 KMT2A (0.44) KMT2AL3MBTL1BTKKDM1AMAOB
SCHEMBL17374170 0.74 KMT2A (0.48) KMT2AL3MBTL1BTKKDM1AMAOB

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10174014-B2 Compounds, compositions, and methods for increasing CFTR activity PROTEOSTASIS THERAPEUTICS, INC. (US) 2019-01-08 — — US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-10174014-B2 Compounds, compositions, and methods for increasing CFTR activity CFTR, ABCB4, SCNN1B KMT2A 4776/4885L3MBTL1 3551/4885ALDH1A1 3298/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.

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